tert-butyl 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]phenoxy]acetate CAS Name: 2-[4-[4-(4-cyanophenyl)-1-piperazinyl]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]phenoxy]acetate Traditional Name: 2-[4-[4-(4-cyanophenyl)piperazino]phenoxy]acetic acid tert-butyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H27N3O3/c1-23(2,3)29-22(27)17-28-21-10-8-20(9-11-21)26-14-12-25(13-15-26)19-6-4-18(16-24)5-7-19/h4-11H,12-15,17H2,1-3H3